⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| Ethyl Isothiocyanate SCHEMBL11120171 | 0.96 | — | — | |
| Ethyl Isothiocyanate SCHEMBL27916476 | 0.96 | — | — | |
| Ethyl Isothiocyanate SCHEMBL8698367 | 0.90 | — | — | |
| Benzene SCHEMBL28186125 | 0.90 | MIF (0.44) | — | |
| Ethyl Isothiocyanate SCHEMBL28386540 | 0.90 | — | — | |
| Ethyl Isothiocyanate SCHEMBL25213788 | 0.90 | — | — | |
| Ethyl Isothiocyanate SCHEMBL1419599 | 0.83 | — | — | |
| Biphenyl SCHEMBL17835321 | 0.77 | MIF (0.50) | — | |
| Toluene SCHEMBL29140425 | 0.75 | MIF (0.48) | — | |
| Acrylic Acid SCHEMBL29047896 | 0.75 | LMNA (0.43) | — |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Appears in 2518 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-122010781-A | Synthesis method of 1-tert-butyl-3-ethylcarbodiimide | 浙江海翔药业股份有限公司 | 2026-05-12 | — | — | CN | claimed |
| US-12519133-B2 | Electrolyte solution for lithium secondary battery and lithium secondary battery including the same | SK ON CO., LTD. (KR) | 2026-01-06 | — | — | US | claimed |
| US-12402638-B2 | Materials and methods for extending shelf-life of foods | JP LABORATORIES, INC. (US) | 2025-09-02 | — | — | US | claimed |
| US-20250194617-A1 | Materials and Methods for Extending Shelf-Life of Foods | JP LABORATORIES, INC. | 2025-06-19 | — | — | US | claimed |
| CN-120059861-A | Efficient scale remover and preparation method thereof | 万华化学集团股份有限公司 | 2025-05-30 | — | — | CN | claimed |
| US-20250169514-A1 | Materials and Methods for Extending Shelf-Life of Foods | JP LABORATORIES, INC. | 2025-05-29 | — | — | US | claimed |
| CN-119422671-B | Red fruit ginseng cutting seedling raising method | 文山壮族苗族自治州农业科学院 | 2025-05-27 | — | — | CN | claimed |
| CN-119547729-B | Tissue culture method for cluster bud induction of peony seed embryo | 西南林业大学 | 2025-05-27 | — | — | CN | claimed |
| US-20250160275-A1 | COMPOUNDS FOR MODIFYING MEIOTIC RECOMBINATION AND METHODS RELATING THERETO | THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL | 2025-05-22 | — | — | US | claimed |
| CN-119234653-B | Planting management method for prolonging flowering period of Funing golden camellia | 云南省林业和草原科学院 | 2025-05-09 | — | — | CN | claimed |
| WO-2000067577-A1 | COMPOSITIONS AND PROCESS FOR NEMATODE CONTROL | ILLOVO SUGAR LIMITED (ZA) | 2000-11-16 | — | — | WO | claimed |
| EP-1017695-A1 | RESOLUTION OF OPTICALLY-ACTIVE COMPOUNDS | MONASH UNIVERSITY (AU) | 2000-07-12 | — | — | EP | claimed |
| EP-0379483-B1 | 1,2,3,4,10,14b-HEXAHYDRODIBENZO c,f]PYRAZINO- 1,2-a]AZEPINO DERIVATIVES | UNIV MONASH (AU) | 1999-12-29 | — | — | EP | claimed |
| WO-1999016769-A1 | RESOLUTION OF OPTICALLY-ACTIVE COMPOUNDS | MONASH UNIVERSITY (AU) | 1999-04-08 | — | — | WO | claimed |
| US-5208378-A | Reaction of ethyl isothiocyanate with N,N-dimethyl-1,3-propane diamine and removal of hydrogen sulfide from thiourea derivatives | RESEARCH ASSOCIATION FOR UTILIZATION OF LIGHT OIL (JP) | 1993-05-04 | — | — | US | claimed |
| WO-1992013530-A1 | TRANSGLUTAMINASE ENZYME INHIBITORS | MEDICIS CORPORATION (US) | 1992-08-20 | — | — | WO | claimed |
| EP-0379483-A4 | 1,2,3,4,10,14B-HEXAHYDRODIBENZO C,F¨PYRAZINO- 1,2-A¨AZEPINO DERIVATIVES AND 10-AZA, 10-OXA AND 10-THIA ANALOGUES | — | 1991-10-09 | — | — | EP | claimed |
| US-5049637-A | 5-hydroxytryptamine antagonist | MONASH UNIVERSITY (AU) | 1991-09-17 | — | — | US | claimed |
| EP-0379483-A1 | 1,2,3,4,10,14b-HEXAHYDRODIBENZO c,f]PYRAZINO- 1,2-a]AZEPINO DERIVATIVES AND 10-AZA, 10-OXA AND 10-THIA ANALOGUES | MONASH UNIVERSITY (AU) | 1990-08-01 | — | — | EP | claimed |
| WO-1988007997-A1 | 1,2,3,4,10,14b-HEXAHYDRODIBENZO[c,f]PYRAZINO-[1,2-a]AZEPINO DERIVATIVES AND 10-AZA, 10-OXA AND 10-THIA ANALOGUES | MONASH UNIVERSITY (AU) | 1988-10-20 | — | — | WO | claimed |